ethyl 2-[5-carbamothioyl-2,6-bis(oxidanylidene)-3-propan-2-yl-pyrimidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-carbamothioyl-2,6-bis(oxidanylidene)-3-propan-2-yl-pyrimidin-1-yl]ethanoate Openeye Name: ethyl 2-(5-carbamothioyl-3-isopropyl-2,6-dioxo-pyrimidin-1-yl)acetate CAS Name: 2-(5-carbamothioyl-2,6-dioxo-3-propan-2-yl-1-pyrimidinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-carbamothioyl-2,6-dioxo-3-propan-2-ylpyrimidin-1-yl)acetate Traditional Name: 2-(3-isopropyl-2,6-diketo-5-thiocarbamoyl-pyrimidin-1-yl)acetic acid ethyl ester Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C(=CN(C1=O)C(C)C)C(=S)N

Isomeric SMILES

CCOC(=O)CN1C(=O)C(=CN(C1=O)C(C)C)C(=S)N

InChI

InChI=1S/C12H17N3O4S/c1-4-19-9(16)6-15-11(17)8(10(13)20)5-14(7(2)3)12(15)18/h5,7H,4,6H2,1-3H3,(H2,13,20)